- InChI
- InChI=1S/C13H25NO/c1-2-3-6-11-14-13(15)10-9-12-7-4-5-8-12/h12H,2-11H2,1H3,(H,14,15)
- InChI Key
- HEGMXJOOZAADQO-UHFFFAOYSA-N
- Formula
- C13H25NO
- SMILES
- CCCCCNC(=O)CCC1CCCC1
- Molecular Weight1
- 211.35
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.6440 | Relay (1.0) Calculated Property | |
| ΔfG° | 55.60 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -432.70 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 30.06 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 76.28 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.95 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.32 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.263 | Crippen Calculated Property | |
| McVol | 194.720 | ml/mol | McGowan Calculated Property |
| Pc | 2047.46 | kPa | Joback Calculated Property |
| Inp | [1816.00; 1816.00] |
|
|
| Inp | 1816.00 | NIST | |
| Inp | 1816.00 | NIST | |
| Tboil | 572.91 | K | Relay (1.0) Calculated Property |
| Tc | 788.15 | K | Relay (1.0) Calculated Property |
| Tfus | 269.32 | K | Relay (1.0) Calculated Property |
| Vc | 0.709 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [534.99; 632.12] | J/mol×K | [616.36; 809.47] |
|
| Cp,gas | 534.99 | J/mol×K | 616.36 | Joback Calculated Property |
| Cp,gas | 553.55 | J/mol×K | 648.54 | Joback Calculated Property |
| Cp,gas | 571.11 | J/mol×K | 680.73 | Joback Calculated Property |
| Cp,gas | 587.71 | J/mol×K | 712.91 | Joback Calculated Property |
| Cp,gas | 603.39 | J/mol×K | 745.10 | Joback Calculated Property |
| Cp,gas | 618.18 | J/mol×K | 777.28 | Joback Calculated Property |
| Cp,gas | 632.12 | J/mol×K | 809.47 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propanamide, 3-cyclopentyl-N-pentyl-.
Sources
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